---------------------------------------------------------------------
        Collecting the numbers for calculating of PNMR               
---------------------------------------------------------------------
 --- TEMPERATURE ----
     293.00000
 ------ GVALUE ------
       1.40482
 --- MULTIPLICITY ---
      2
---------------------------------------------------------------------
                             GT(B,S)                                 
---------------------------------------------------------------------
        2.2217343298       -0.3879062666        0.1348590258
       -0.3826406780        1.8630736219        0.2664603120
        0.1355503216        0.2718074886        2.3730150816


   Component         Value                Principal Axis 
    GT_11           1.512946         0.4982    0.8024   -0.3287
    GT_22           2.443049         0.7629   -0.2254    0.6059
    GT_33           2.501836        -0.4121    0.5526    0.7244
    GT_iso          2.152610

---------------------------------------------------------------------
                           HFS(I,S) [MHz]                            
---------------------------------------------------------------------
        0.0796994387        0.3054523744       -0.1036810129
       -0.0298097809        0.0706787605       -0.1796463758
        0.1546951684        0.0163371710       -0.0609759325


               Symmetrized by prescription: (A+A^T)/2
               --------------------------------------

   Component         Value                Principal Axis 
   HFS_11          -0.140357        -0.4308    0.5563    0.7106
   HFS_22           0.010965         0.5904   -0.4218    0.6881
   HFS_33           0.218794         0.6825    0.7160   -0.1467
   HFS_iso          0.029801


                Symmetrized by prescription:  A*A^T
                -----------------------------------

   Component         Value                Principal Axis 
   HFS_11           0.140290         0.4261   -0.5967   -0.6800
   HFS_22           0.156102         0.1200   -0.7078    0.6962
   HFS_33           0.363904         0.8967    0.3782    0.2300
   HFS_iso          0.220099

---------------------------------------------------------------------
                             CS(mu,B)                                
---------------------------------------------------------------------
        0.0000000000        0.0000000000        0.0000000000
        0.0000000000        0.0000000000        0.0000000000
        0.0000000000        0.0000000000        0.0000000000


 Component           Value                Principal Axis 
 SIGMA_11           0.000000         1.0000    0.0000    0.0000
 SIGMA_22           0.000000         0.0000    1.0000    0.0000
 SIGMA_33           0.000000         0.0000    0.0000    1.0000
 SIGMA_iso          0.000000

---------------------------------------------------------------------
                           Final results                             
---------------------------------------------------------------------

 ----- G * HFS_iso --> FC -----
       -3.5395460712        0.6096022780       -0.2159513862
        0.6179911268       -2.9681473749       -0.4330288800
       -0.2148500514       -0.4245100496       -3.7805583216

 ----- G * HFS_ani --> PC -----
        1.1551398444      -24.3475718560       11.9176410120
        9.8410296817       -2.1221730885       25.7597030627
      -14.0557717866        5.3740022130       10.1576438185

 ----- CS_orb -----
        0.0000000000        0.0000000000        0.0000000000
        0.0000000000        0.0000000000        0.0000000000
        0.0000000000        0.0000000000        0.0000000000

 ----- GT * HFS -----
       -2.3844062268      -27.3157192309        8.1370826904
        6.3014836105       -5.0903204635       21.9791447411
      -17.5953178578        2.4058548381        6.3770854968

 ------- PNMR(mu,B) -------
       -2.3844062268      -27.3157192309        8.1370826904
        6.3014836105       -5.0903204635       21.9791447411
      -17.5953178578        2.4058548381        6.3770854968
  
  The values of the principal components of PNMR-tensor
  
  Component          Value             Principal Axis 
---------------------------------------------------------------------
  SIGMA_11        -16.463281         0.4914    0.8065   -0.3288
  SIGMA_22         -3.408059         0.7551   -0.2065    0.6222
  SIGMA_33         18.773698        -0.4339    0.5540    0.7105
---------------------------------------------------------------------

 ISOTROPIC pNMR shielding contributions: 
 Orb =       0.0000
 FC  =      -3.4294
 PC  =       3.0635
 SUM =      -0.3659
  
 ***************************************************
 * Well, here we are. How does it look for you ??? *
 ***************************************************
